![7,7-dimethyl-2-phenyl-4-((2-(pyrrolidin-1-yl)ethyl)thio)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine structure](/static/products/901/901271-18-9.png)
7,7-dimethyl-2-phenyl-4-((2-(pyrrolidin-1-yl)ethyl)thio)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine
TL;DR: 7,7-dimethyl-2-phenyl-4-((2-(pyrrolidin-1-yl)ethyl)thio)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine (CAS 901271-18-9) is a chemical compound with molecular formula C21H27N3OS and molecular weight 369.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7,7-dimethyl-2-phenyl-4-(2-pyrrolidin-1-ylethylsulfanyl)-5,8-dihydropyrano[4,3-d]pyrimidine
Also Known As: 7,7-dimethyl-2-phenyl-4-((2-(pyrrolidin-1-yl)ethyl)thio)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine, 7,7-dimethyl-2-phenyl-4-(2-pyrrolidin-1-ylethylsulfanyl)-5,8-dihydropyrano[4,3-d]pyrimidine, 7,7-dimethyl-2-phenyl-4-{[2-(pyrrolidin-1-yl)ethyl]sulfanyl}-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine
| Molecular Formula | C21H27N3OS |
|---|---|
| Molecular Weight | 369.19 g/mol |
| LogP | 4.1828 |
| Topological Polar Surface Area | 38.25 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 369.18747 |
| Heavy Atoms | 26 |
| Complexity | 757.35156 |
Chemical Identifiers
| CAS Number | 901271-18-9 |
|---|---|
| SMILES | CC1(CC2=C(CO1)C(=NC(=N2)C3=CC=CC=C3)SCCN4CCCC4)C |
Product Overview
7,7-dimethyl-2-phenyl-4-((2-(pyrrolidin-1-yl)ethyl)thio)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine (CAS 901271-18-9), with molecular formula C21H27N3OS and molecular weight 369.19 g/mol. IUPAC: 7,7-dimethyl-2-phenyl-4-(2-pyrrolidin-1-ylethylsulfanyl)-5,8-dihydropyrano[4,3-d]pyrimidine.
Chemical Property Profile of 7,7-dimethyl-2-phenyl-4-((2-(pyrrolidin-1-yl)ethyl)thio)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine
Property Insights of 7,7-dimethyl-2-phenyl-4-((2-(pyrrolidin-1-yl)ethyl)thio)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine
The XLogP value of 4.1828 indicates that 7,7-dimethyl-2-phenyl-4-((2-(pyrrolidin-1-yl)ethyl)thio)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.25 Ų, 7,7-dimethyl-2-phenyl-4-((2-(pyrrolidin-1-yl)ethyl)thio)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7,7-dimethyl-2-phenyl-4-((2-(pyrrolidin-1-yl)ethyl)thio)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 7,7-dimethyl-2-phenyl-4-((2-(pyrrolidin-1-yl)ethyl)thio)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine?
The CAS number of 7,7-dimethyl-2-phenyl-4-((2-(pyrrolidin-1-yl)ethyl)thio)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine is 901271-18-9.
What is the molecular formula of 7,7-dimethyl-2-phenyl-4-((2-(pyrrolidin-1-yl)ethyl)thio)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine?
The molecular formula of 7,7-dimethyl-2-phenyl-4-((2-(pyrrolidin-1-yl)ethyl)thio)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine is C21H27N3OS.
What is the molecular weight of 7,7-dimethyl-2-phenyl-4-((2-(pyrrolidin-1-yl)ethyl)thio)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine?
The molecular weight of 7,7-dimethyl-2-phenyl-4-((2-(pyrrolidin-1-yl)ethyl)thio)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine is 369.19 g/mol.
Where can I buy 7,7-dimethyl-2-phenyl-4-((2-(pyrrolidin-1-yl)ethyl)thio)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine?
You can request a quote for 7,7-dimethyl-2-phenyl-4-((2-(pyrrolidin-1-yl)ethyl)thio)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7,7-dimethyl-2-phenyl-4-((2-(pyrrolidin-1-yl)ethyl)thio)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 7,7-dimethyl-2-phenyl-4-((2-(pyrrolidin-1-yl)ethyl)thio)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.